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<p>The block of informational messages that starts with "<font
color="#0000ff">initializing oneAPI environment</font>" and ends
with "<font color="#008000">oneAPI environment initialized</font>"
is normal. However, the <font color="#ff0000">WARNING</font>
message after that is not normal. Although, it is just a warning
such that oneAPI will likely still work fine. However, just as
the warning says it is detecting that you are running <font
color="#ff8000">setvars.sh more than one time </font>in your
.bashrc (or .cshrc). Thus, if you edit .bashrc to have only the
one source line with the setvars.sh then the warning should
disappear.<br>
</p>
<p><br>
</p>
<p>Kind Regards,</p>
<p>Gavin</p>
<p>WIEN2k user<br>
</p>
<p><br>
</p>
<div class="moz-cite-prefix">On 3/8/2022 5:25 PM, delamora wrote:<br>
</div>
<blockquote type="cite"
cite="mid:SN6PR06MB5311753BEC295605569183F3CB3C9@SN6PR06MB5311.namprd06.prod.outlook.com">
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<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
Thank you Gavin,</div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
Sorry for replying so late.<br>
</div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
<br>
</div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
I have Fedora,</div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
I put; source /opt/intel/oneapi/setvars.sh intel64<br>
</div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
I still get many messages:</div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
------------------------------</div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
:: <font color="#0000ff">initializing oneAPI environment</font>
...
<div> -bash: BASH_VERSION = 5.1.8(1)-release</div>
<div> args: Using "$@" for setvars.sh arguments: intel64</div>
<div>:: advisor -- latest</div>
<div>:: ccl -- latest</div>
<div>:: clck -- latest</div>
<div>:: compiler -- latest</div>
<div>:: dal -- latest</div>
<div>:: debugger -- latest</div>
<div>:: dev-utilities -- latest</div>
<div>:: dnnl -- latest</div>
<div>:: dpcpp-ct -- latest</div>
<div>:: dpl -- latest</div>
<div>:: inspector -- latest</div>
<div>:: intelpython -- latest</div>
<div>:: ipp -- latest</div>
<div>:: ippcp -- latest</div>
<div>:: ipp -- latest</div>
<div>:: itac -- latest</div>
<div>:: mkl -- latest</div>
<div>:: mpi -- latest</div>
<div>:: tbb -- latest</div>
<div>:: vpl -- latest</div>
<div>:: vtune -- latest</div>
<div>:: <font color="#008000">oneAPI environment initialized</font>
::</div>
<div> </div>
<div> </div>
<div>:: <font color="#ff0000">WARNING</font>: <font
color="#ff8000">setvars.sh has already been run</font>.
Skipping re-execution.</div>
<div> To force a re-execution of setvars.sh, use the '--force'
option.</div>
<div> Using '--force' can result in excessive use of your
environment variables.</div>
<div> </div>
<div>usage: source setvars.sh [--force] [--config=file] [--help]
[...]</div>
<div> --force Force setvars.sh to re-run, doing so may
overload environment.</div>
<div> --config=file Customize env vars using a setvars.sh
configuration file.</div>
<div> --help Display this help message and exit.</div>
<div> ... Additional args are passed to individual
env/vars.sh scripts</div>
<div> and should follow this script's arguments.</div>
<div> </div>
<div> Some POSIX shells do not accept command-line options. In
that case, you can pass</div>
<div> command-line options via the SETVARS_ARGS environment
variable. For example:</div>
<div> </div>
<div> $ SETVARS_ARGS="ia32 --config=config.txt" ; export
SETVARS_ARGS</div>
<div> $ . path/to/setvars.sh</div>
<div> </div>
<span> The SETVARS_ARGS environment variable is cleared on
exiting setvars.sh.</span></div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
<span>--------------------------</span></div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
<br>
</div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
Is this ok?<br>
<span></span></div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
<br>
</div>
<hr tabindex="-1" style="display:inline-block; width:98%">
<div id="divRplyFwdMsg" dir="ltr"><font style="font-size:11pt"
face="Calibri, sans-serif" color="#000000"><b>De:</b> Wien
<a class="moz-txt-link-rfc2396E" href="mailto:wien-bounces@zeus.theochem.tuwien.ac.at"><wien-bounces@zeus.theochem.tuwien.ac.at></a> en nombre de
Gavin Abo <a class="moz-txt-link-rfc2396E" href="mailto:gabo13279@gmail.com"><gabo13279@gmail.com></a><br>
<b>Enviado:</b> miércoles, 23 de febrero de 2022 01:03 a. m.<br>
<b>Para:</b> <a class="moz-txt-link-abbreviated" href="mailto:wien@zeus.theochem.tuwien.ac.at">wien@zeus.theochem.tuwien.ac.at</a>
<a class="moz-txt-link-rfc2396E" href="mailto:wien@zeus.theochem.tuwien.ac.at"><wien@zeus.theochem.tuwien.ac.at></a><br>
<b>Asunto:</b> Re: [Wien] Install Wien2k using oneAPI</font>
<div> </div>
</div>
<div>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
I believe it might have been the webpage at [1] that I
followed to install oneAPI within Ubuntu, which had me run a
single terminal command to install it:<br>
</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
<br>
</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
sudo apt install intel-hpckit</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
<br>
</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
I think I came across that webpage on the website at [2]
having links to installation of oneAPI also for other Package
Managers used by other Linux distributions such as Fedora,
CentOS, etc.</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
<br>
</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
For the source line in .bashrc, I think it was webpages [3,4]
that I followed to put oneAPI (such as the ifort compiler) in
the operating system environment which had me use:<br>
</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
<br>
</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
source /opt/intel/oneapi/setvars.sh intel64</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
<br>
</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
[1] <a class="x_moz-txt-link-freetext moz-txt-link-freetext"
href="https://www.intel.com/content/www/us/en/develop/documentation/installation-guide-for-intel-oneapi-toolkits-linux/top/installation/install-using-package-managers/apt.html#apt"
moz-do-not-send="true">
https://www.intel.com/content/www/us/en/develop/documentation/installation-guide-for-intel-oneapi-toolkits-linux/top/installation/install-using-package-managers/apt.html#apt</a></p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
[2] <a class="x_moz-txt-link-freetext moz-txt-link-freetext"
href="https://www.intel.com/content/www/us/en/develop/documentation/installation-guide-for-intel-oneapi-toolkits-linux/top/installation/install-using-package-managers.html#install-using-package-managers"
moz-do-not-send="true">
https://www.intel.com/content/www/us/en/develop/documentation/installation-guide-for-intel-oneapi-toolkits-linux/top/installation/install-using-package-managers.html#install-using-package-managers</a><br>
</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
[3] <a class="x_moz-txt-link-freetext moz-txt-link-freetext"
href="https://www.intel.com/content/www/us/en/develop/documentation/fortran-compiler-oneapi-dev-guide-and-reference/top/compiler-setup/using-the-command-line/specifying-the-location-of-compiler-components.html"
moz-do-not-send="true">
https://www.intel.com/content/www/us/en/develop/documentation/fortran-compiler-oneapi-dev-guide-and-reference/top/compiler-setup/using-the-command-line/specifying-the-location-of-compiler-components.html</a><br>
</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
[4] <a class="x_moz-txt-link-freetext moz-txt-link-freetext"
href="https://estuarine.jp/2021/03/install-oneapi/?lang=en"
moz-do-not-send="true">
https://estuarine.jp/2021/03/install-oneapi/?lang=en</a></p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
<br>
</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
Kind Regards,</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
Gavin</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
WIEN2k user<br>
</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
<br>
</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top: 0px;
margin-bottom: 0px;">
On 2/22/2022 12:29 PM, delamora wrote:<br>
</p>
<blockquote type="cite">
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
I installed the intel oneAPI <br>
</div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
I have in /etc/bashrc;<br>
</div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
source
/opt/intel/compilers_and_libraries_2019.0.117/linux/bin/compilervars.sh
-arch intel64 -platform linux</div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
Now I need the oneAPI source <br>
</div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
<br>
</div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
Saludos</div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
<br>
</div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
Pablo<br>
</div>
<div style="font-family:Calibri,Arial,Helvetica,sans-serif;
font-size:12pt; color:rgb(0,0,0)">
<br>
</div>
<hr tabindex="-1" style="display:inline-block; width:98%">
<div id="x_divRplyFwdMsg" dir="ltr"><font
style="font-size:11pt" face="Calibri, sans-serif"
color="#000000"><b>De:</b> Wien
<a class="x_moz-txt-link-rfc2396E"
href="mailto:wien-bounces@zeus.theochem.tuwien.ac.at"
moz-do-not-send="true">
<wien-bounces@zeus.theochem.tuwien.ac.at></a> en
nombre de Peter Blaha <a class="x_moz-txt-link-rfc2396E"
href="mailto:pblaha@theochem.tuwien.ac.at"
moz-do-not-send="true">
<pblaha@theochem.tuwien.ac.at></a><br>
<b>Enviado:</b> jueves, 11 de marzo de 2021 09:59 a. m.<br>
<b>Para:</b> <a class="x_moz-txt-link-abbreviated
moz-txt-link-freetext"
href="mailto:wien@zeus.theochem.tuwien.ac.at"
moz-do-not-send="true">
wien@zeus.theochem.tuwien.ac.at</a> <a
class="x_moz-txt-link-rfc2396E"
href="mailto:wien@zeus.theochem.tuwien.ac.at"
moz-do-not-send="true">
<wien@zeus.theochem.tuwien.ac.at></a><br>
<b>Asunto:</b> Re: [Wien] Install Wien2k using oneAPI</font>
<div> </div>
</div>
<div>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top:
0px; margin-bottom: 0px;">
I just installed oneAPI today (it is free !!!). You need
the Base and the HPC (high performance computing) toolkit.</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top:
0px; margin-bottom: 0px;">
It was trivial to install, but the setting of the
environment is slightly different.</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top:
0px; margin-bottom: 0px;">
<br>
</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top:
0px; margin-bottom: 0px;">
Once installed, WIEN2k compiles with the standard option
(ifort+mkl) without any changes.<br>
</p>
<p style="margin-top: 0px; margin-bottom: 0px;margin-top:
0px; margin-bottom: 0px;">
<br>
</p>
<div class="x_x_moz-cite-prefix">Am 11.03.2021 um 16:52
schrieb Laurence Marks:<br>
</div>
<blockquote type="cite">
<div dir="ltr">
<div class="x_x_gmail_default"
style="font-family:verdana,sans-serif; color:#000000">
Since nobody has responded, I will. I have oneAPI
running without any issue for some months. Of course
sometimes the installation is tricky. I suggest going
ahead, then coming back to the list if there are any
problems.</div>
</div>
<br>
<div class="x_x_gmail_quote">
<div dir="ltr" class="x_x_gmail_attr">On Wed, Mar 10,
2021 at 12:38 AM Riyajul Islam <<a
href="mailto:riyajul80@gmail.com"
class="x_moz-txt-link-freetext
moz-txt-link-freetext" moz-do-not-send="true">riyajul80@gmail.com</a>>
wrote:<br>
</div>
<blockquote class="x_x_gmail_quote" style="margin:0px
0px 0px 0.8ex; border-left:1px solid rgb(204,204,204);
padding-left:1ex">
<div dir="ltr">Dear Wien2k users,<br>
<div>I have used Intel parallel studio for intel
fortran compiler to install Wien2k 19.2 but the
license has expired. As they have recently
transitioned from Intel Parallel Studio XE to
Intel oneAPI, so is there any way that I can
install Wien2k using Intel oneAPI?</div>
<div><br>
</div>
<div>Kind regards</div>
-- <br>
<div dir="ltr">
<div dir="ltr">
<div dir="ltr"><font color="#444444">Riyajul
Islam</font>
<div><font color="#444444">National Institute
of Technology Nagaland</font></div>
<br>
</div>
</div>
</div>
</div>
</blockquote>
</div>
-- <br>
<div dir="ltr" class="x_x_gmail_signature">
<div dir="ltr">Professor Laurence Marks<br>
Department of Materials Science and Engineering<br>
Northwestern University<br>
<a href="http://www.numis.northwestern.edu/"
target="_blank" moz-do-not-send="true">www.numis.northwestern.edu</a>
<div>"Research is to see what everybody else has seen,
and to think what nobody else has thought" Albert <span
style="font-family:Arial,Helvetica,sans-serif;
font-size:12.8px">Szent-</span><span
style="font-family:Arial,Helvetica,sans-serif;
font-size:small; color:rgb(34,34,34)">Györgyi</span></div>
</div>
</div>
<br>
<fieldset class="x_x_mimeAttachmentHeader"></fieldset>
</blockquote>
<pre class="x_x_moz-signature" cols="72">--
-----------------------------------------------------------------------
Peter Blaha, Inst. f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-158801165300
Email: <a class="x_x_moz-txt-link-abbreviated x_moz-txt-link-freetext moz-txt-link-freetext" href="mailto:peter.blaha@tuwien.ac.at" moz-do-not-send="true">peter.blaha@tuwien.ac.at</a>
WWW: <a class="x_x_moz-txt-link-freetext x_moz-txt-link-freetext moz-txt-link-freetext" href="http://www.imc.tuwien.ac.at" moz-do-not-send="true">http://www.imc.tuwien.ac.at</a> WIEN2k: <a class="x_x_moz-txt-link-freetext x_moz-txt-link-freetext moz-txt-link-freetext" href="http://www.wien2k.at" moz-do-not-send="true">http://www.wien2k.at</a>
-------------------------------------------------------------------------</pre>
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</blockquote>
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